3-butylsulfonyl-2,6-bis(chloranyl)benzoic acid

Systemtic Name: 3-butylsulfonyl-2,6-bis(chloranyl)benzoic acid Openeye Name: 3-butylsulfonyl-2,6-dichloro-benzoic acid CAS Name: 3-butylsulfonyl-2,6-dichlorobenzoic acid IUPAC Name: 3-butylsulfonyl-2,6-dichlorobenzoic acid Traditional Name: 3-butylsulfonyl-2,6-dichloro-benzoic acid Formula: C11H12Cl2O4S MolecularWeight: 311.18158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=C(C(=C(C=C1)Cl)C(=O)O)Cl

Isomeric SMILES

CCCCS(=O)(=O)C1=C(C(=C(C=C1)Cl)C(=O)O)Cl

InChI

InChI=1S/C11H12Cl2O4S/c1-2-3-6-18(16,17)8-5-4-7(12)9(10(8)13)11(14)15/h4-5H,2-3,6H2,1H3,(H,14,15)